Geometry & MOs

Info

ID:	323729
PubChem CID:	126675852
Reduced:	N3O8C13H27 (1)
Stoich.:	A3B8C13D27 (1)
Weight, g/mol:	1166.451633
ΔH_f, kcal/mol:	-365.2
Dipole, Da:	6.6
IP(EA), eV:	-9.71(0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,4S,5S)-5-[(2R,3R)-1-acetyloxy-4,6-diazido-3-[(2S,4R,5S)-4,5-diacetyloxy-6-[(1R)-1-acetyloxyethyl]-3-azidooxan-2-yl]oxyhexan-2-yl]oxy-4-benzoyloxy-2-[[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]methyl]oxolan-3-yl] benzoate

Drug info:

PubChemData

Geometry & MOs

Info

ID:

PubChem CID:

Reduced:

Stoich.:

Weight, g/mol:

ΔH_f, kcal/mol:

Dipole, Da:

IP(EA), eV:

Spin(S_z, S²):

Charge, e:

Chem-info

IUPAC name:

Drug info:

Smile

C1[C@H](C(C([C@@H](C1N)O[C@@H]2C(C([C@@H](C(O2)[C@@H](CO)O)O)O)N)O)O)N

DOS

IR

Vibrations

Geometry & MOs

Info

ID:

PubChem CID:

Reduced:

Stoich.:

Weight, g/mol:

ΔHf, kcal/mol:

Dipole, Da:

IP(EA), eV:

Spin(Sz, S2):

Charge, e:

Chem-info

IUPAC name:

Drug info:

Smile

C1[C@H](C(C([C@@H](C1N)O[C@@H]2C(C([C@@H](C(O2)[C@@H](CO)O)O)O)N)O)O)N

DOS

IR

Vibrations

ΔH_f, kcal/mol:

Spin(S_z, S²):